SCHEMBL5260012

SCHEMBL5260012

CC(c1ccc(Cl)cc1)C(CNC(=O)c1ccc(-c2ccccc2)cc1)c1ccc(Cl)cc1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 9/20 0.53
SMN1; SMN2 Q16637 3/20 0.52
RAB9A P51151 2/20 0.52
NPC1 O15118 1/20 0.52
GPR139 Q6DWJ6 1/20 0.52
CYP27B1 O15528 2/20 0.52
CYP24A1 Q07973 2/20 0.52
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
PRCP P42785 2/20 0.51
MAPT P10636 1/20 0.50
SLC6A9 P48067 1/20 0.50
SLC6A5 Q9Y345 1/20 0.50

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5262774 0.92 SLC6A9 (0.54) UTS2RSMN1; SMN2RAB9ANPC1GPR139
SCHEMBL5266049 0.91 RAB9A (0.60) SMN1; SMN2RAB9ANPC1GPR139MEN1
SCHEMBL5261394 0.86 SMN1; SMN2 (0.48) UTS2RSMN1; SMN2RAB9AGPR139CYP27B1
SCHEMBL5260794 0.86 MEN1 (0.45) UTS2RSMN1; SMN2RAB9AGPR139CYP27B1
SCHEMBL5262488 0.85 SLC6A9 (0.55) UTS2RSMN1; SMN2RAB9ANPC1GPR139
SCHEMBL5263124 0.84 MEN1 (0.44) UTS2RSMN1; SMN2RAB9AGPR139CYP27B1
SCHEMBL5373381 0.82 UTS2R (0.55) UTS2RSMN1; SMN2RAB9ANPC1MEN1
SCHEMBL5262392 0.82 SLC6A9 (0.53) SMN1; SMN2RAB9ACYP27B1CYP24A1MEN1
SCHEMBL5264331 0.81 LMNA (0.52) SMN1; SMN2GPR139CYP27B1CYP24A1MEN1
SCHEMBL5264039 0.81 KMT2A (0.53) SMN1; SMN2RAB9ANPC1GPR139MEN1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1494997-A4 SUBSTITUTED ARYL AMIDES MERCK & CO INC (US) 2007-04-11 EP claimed
JP-2005527586-A 2005-09-15 JP claimed
EP-1494997-A1 SUBSTITUTED ARYL AMIDES Merck & Co., Inc. (US) 2005-01-12 EP claimed
WO-2003087037-A1 SUBSTITUTED ARYL AMIDES MERCK & CO., INC. (US) 2003-10-23 WO claimed
EP-1494997-A4 SUBSTITUTED ARYL AMIDES MERCK & CO INC (US) 2007-04-11 EP disclosed
EP-1494997-A1 SUBSTITUTED ARYL AMIDES Merck & Co., Inc. (US) 2005-01-12 EP disclosed
WO-2003087037-A1 SUBSTITUTED ARYL AMIDES MERCK & CO., INC. (US) 2003-10-23 WO disclosed